1-(4-bromanylbutyl)-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-(4-bromanylbutyl)-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-(4-bromobutyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 1-(4-bromobutyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-(4-bromobutyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 1-(4-bromobutyl)-3,7-dimethyl-xanthine Formula: C11H15BrN4O2 MolecularWeight: 315.1664

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCBr

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCBr

InChI

InChI=1S/C11H15BrN4O2/c1-14-7-13-9-8(14)10(17)16(6-4-3-5-12)11(18)15(9)2/h7H,3-6H2,1-2H3